7F4S
Crystal structure of TthMTA1-PteMTA9 complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL18U1 |
| Synchrotron site | SSRF |
| Beamline | BL18U1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-05-22 |
| Detector | DECTRIS PILATUS3 6M |
| Wavelength(s) | 0.97915 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 75.699, 75.647, 142.471 |
| Unit cell angles | 90.00, 99.16, 90.00 |
Refinement procedure
| Resolution | 44.930 - 3.090 |
| R-factor | 0.3047 |
| Rwork | 0.304 |
| R-free | 0.31560 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 7f4r |
| RMSD bond length | 0.011 |
| RMSD bond angle | 1.654 |
| Data reduction software | HKL-3000 |
| Data scaling software | HKL-3000 |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.17.1_3660) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 3.150 |
| High resolution limit [Å] | 3.090 | 3.090 |
| Rpim | 0.154 | 0.498 |
| Number of reflections | 32542 | 1471 |
| <I/σ(I)> | 5.25 | 1.29 |
| Completeness [%] | 99.2 | |
| Redundancy | 5.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 289 | 0.1M Tris-HCl, pH 7.5, 0.2 M LiCl, 14% PEG 8000 |
